2-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]ethyl 3-oxidanylidenebutanoate

Systemtic Name: 2-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]ethyl 3-oxidanylidenebutanoate Openeye Name: 2-[4-(3-chloro-4-methyl-phenyl)piperazin-1-yl]ethyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 2-[4-(3-chloro-4-methylphenyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]ethyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 2-[4-(3-chloro-4-methyl-phenyl)piperazino]ethyl ester Formula: C17H23ClN2O3 MolecularWeight: 338.82912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)CCOC(=O)CC(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)CCOC(=O)CC(=O)C)Cl

InChI

InChI=1S/C17H23ClN2O3/c1-13-3-4-15(12-16(13)18)20-7-5-19(6-8-20)9-10-23-17(22)11-14(2)21/h3-4,12H,5-11H2,1-2H3